N-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(phenylmethyl)-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(phenylmethyl)-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-benzyl-N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(phenylmethyl)-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-benzyl-N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-benzyl-N-[(2-keto-7,8-dimethyl-1H-quinolin-3-yl)methyl]-2-piperidin-1-ium-1-yl-acetamide Formula: C26H32N3O2+ MolecularWeight: 418.55118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=CC=C3)C(=O)C[NH+]4CCCCC4)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=CC=C3)C(=O)C[NH+]4CCCCC4)C

InChI

InChI=1S/C26H31N3O2/c1-19-11-12-22-15-23(26(31)27-25(22)20(19)2)17-29(16-21-9-5-3-6-10-21)24(30)18-28-13-7-4-8-14-28/h3,5-6,9-12,15H,4,7-8,13-14,16-18H2,1-2H3,(H,27,31)/p+1